[2-(1-adamantyl)-2-oxidanylidene-ethyl] thiophene-2-carboxylate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] thiophene-2-carboxylate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C17H20O3S MolecularWeight: 304.4039

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)C4=CC=CS4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)C4=CC=CS4

InChI

InChI=1S/C17H20O3S/c18-15(10-20-16(19)14-2-1-3-21-14)17-7-11-4-12(8-17)6-13(5-11)9-17/h1-3,11-13H,4-10H2